4-bromo-N'-{[5-nitro-2-(pyrrolidin-1-yl)phenyl]methylidene}benzohydrazide
Chemical Structure Depiction of
4-bromo-N'-{[5-nitro-2-(pyrrolidin-1-yl)phenyl]methylidene}benzohydrazide
4-bromo-N'-{[5-nitro-2-(pyrrolidin-1-yl)phenyl]methylidene}benzohydrazide
Compound characteristics
Compound ID: | 8002-0870 |
Compound Name: | 4-bromo-N'-{[5-nitro-2-(pyrrolidin-1-yl)phenyl]methylidene}benzohydrazide |
Molecular Weight: | 417.26 |
Molecular Formula: | C18 H17 Br N4 O3 |
Smiles: | C1CCN(C1)c1ccc(cc1/C=N/NC(c1ccc(cc1)[Br])=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.8177 |
logD: | 4.8144 |
logSw: | -4.8957 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.453 |
InChI Key: | XAWPNUAWIXHIHH-UHFFFAOYSA-N |